SCHEMBL8048024

SCHEMBL8048024

Clc1cccc2sc(Sc3nnc(-c4cccs4)n3CCc3ccccc3)nc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
ALDH1A1 P00352 6/20 0.43
LMNA P02545 5/20 0.43
RAB9A P51151 5/20 0.43
MAPT P10636 4/20 0.43
HTT P42858 3/20 0.43
HSD17B10 Q99714 3/20 0.43
NPC1 O15118 2/20 0.43
POLB P06746 2/20 0.43
GALR3 O60755 1/20 0.43
ESR2 Q92731 1/20 0.43
CTDSP1 Q9GZU7 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
CPB1 P15086 1/20 0.41
USP2 O75604 3/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8043994 0.85 ALDH1A1 (0.53) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8042833 0.83 KMT2A (0.48) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8050831 0.83 HSP90AA1 (0.46) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8042284 0.83 TSHR (0.56) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8044158 0.82 TSHR (0.54) TSHRSMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL8043169 0.81 HSP90AA1 (0.46) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8044230 0.79 RAB9A (0.47) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8042595 0.79 RAB9A (0.47) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8033238 0.78 RAB9A (0.52) TSHRSMN1; SMN2ALDH1A1LMNARAB9A
SCHEMBL8048029 0.78 TSHR (0.42) TSHRSMN1; SMN2ALDH1A1LMNARAB9A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6080772-A 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY SUGEN, INC. (US) 2000-06-27 US disclosed